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Wenkite |
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Merlino S |
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Acta Crystallographica B30 (1974) 1262-1266 |
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The crystal structure of wenkite |
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Locality: Candoglia, Italy |
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_database_code_amcsd 0009505 |
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13.511 13.511 7.462 90 90 120 P-62m |
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atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Ba1 0 0 .5 .875 .0042 .0042 .0068 .0021 0 0 |
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K1 0 0 .5 .125 .0042 .0042 .0068 .0021 0 0 |
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Ba2 .3932 0 .5 .875 .0015 .0024 .0136 .00075 0 0 |
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K2 .3932 0 .5 .125 .0015 .0024 .0136 .00075 0 0 |
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Ca1 .4988 .2743 0 .9167 .0025 .0037 .0155 .0010 0 0 |
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Na1 .4988 .2743 0 .0833 .0025 .0037 .0155 .0010 0 0 |
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Si1 .2666 .1336 .2178 .6 .8 |
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Al1 .2666 .1336 .2178 .4 .8 |
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Si2 .4380 .3008 .5 .56 .4 |
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Al2 .4380 .3008 .5 .44 .4 |
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Si3 2/3 1/3 .397 .11 .4 |
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Al3 2/3 1/3 .397 .39 .4 |
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S .5200 .5200 0 1.3 |
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O1 .296 .145 0 .2 |
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O2 .392 .215 .317 1.4 |
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O3 .216 0 .294 .8 |
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O4 .170 .170 .275 1.0 |
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O5 .399 .399 .5 2.2 |
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O6 .580 .378 .5 1.3 |
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O7 2/3 1/3 .170 .5 3.0 |
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OH7 2/3 1/3 .170 .5 3.0 |
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O8 .421 .402 -.049 .25 .9 |
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O9 .492 .606 .074 .25 2.6 |
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O10 .599 .553 -.158 .25 1.6 |
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O11 .591 .499 .154 .25 2.9 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Wenkite |
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Wenk H R |
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Zeitschrift fur Kristallographie 137 (1973) 113-126 |
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The structure of wenkite |
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Locality: Cava Mergozzoni, Candoglia, Norvara, Italy |
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_database_code_amcsd 0010743 |
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13.515 13.515 7.465 90 90 120 P-62m |
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atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Ba1 0 0 .015 .48 1.2 .0021 .0021 .0104 .00105 0 0 |
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Ba2 .3927 0 .0212 .5 1.05 .0020 .0020 .0149 .0010 0 0 |
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Ca .2243 -.2753 .488 .41 1.8 .0050 .0033 .0110 .0030 0 0 |
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Al1 .1378 -.3006 0 .651 .67 |
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Si1 .1378 -.3006 0 .349 .67 |
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Al2 1/3 -1/3 .103 .325 .4 |
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Si2 1/3 -1/3 .103 .175 .4 |
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Al3 .1333 -.1335 .2820 .651 .75 |
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Si3 .1333 -.1335 .2820 .349 .75 |
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O1 0 -.400 0 1.9 |
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O2 .207 -.376 0 1.4 |
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O3 .216 0 .208 1.4 |
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O4 .179 -.215 .182 1.8 |
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O5 0 -.171 .219 1.5 |
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OH6 1/3 2/3 .320 .5 1.0 |
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O7 .150 -.144 .5 1.3 |
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S1 .4831 0 .5 1.5 |
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O8 .430 0 .327 .5 6.9 |
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O9 .493 -.406 .394 .5 5.8 |
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O10 0 -.408 .5 .5 5.0 |
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Wat 0 0 .5 .24 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
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